4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol

C13H27N3O — CID 55048858

IUPAC4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol
SMILESCN1CCC(N(C)CC2(O)CCNCC2)CC1
InChIInChI=1S/C13H27N3O/c1-15-9-3-12(4-10-15)16(2)11-13(17)5-7-14-8-6-13/h12,14,17H,3-11H2,1-2H3
InChIKeyQTLNUHWNRSWKIR-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.13
Rot. Bonds3

About 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol

4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol (PubChem CID 55048858) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol.

Molecular Properties

Compound Name4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol
PubChem CID55048858
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol
SMILESCN1CCC(N(C)CC2(O)CCNCC2)CC1
InChIInChI=1S/C13H27N3O/c1-15-9-3-12(4-10-15)16(2)11-13(17)5-7-14-8-6-13/h12,14,17H,3-11H2,1-2H3
InChIKeyQTLNUHWNRSWKIR-UHFFFAOYSA-N
XLogP0.13
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[[azetidin-3-yl(methyl)amino]methyl]piperidin-4-ol
CID 126846975
4-[[methyl-(1-methylpiperidin-3-yl)amino]methyl]piperidin-4-ol
CID 62546239
4-hydroxy-4-[[methyl(piperidin-4-yl)amino]methyl]cyclohexane-1-carboxylic acid
CID 106498506
N,1-dimethyl-N-(piperazin-1-ylmethyl)piperidin-4-amine
CID 115229945
1-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]cyclopentan-1-ol
CID 65212623
1-[[(4-aminocyclohexyl)-methylamino]methyl]cyclopropan-1-ol
CID 172599097
N-[[1-(aminomethyl)cyclopropyl]methyl]-N,1-dimethylpiperidin-4-amine
CID 115453628
N-[(1-aminocyclohexyl)methyl]-N,1-dimethylpiperidin-4-amine
CID 28598778
4-[[methyl(pentan-3-yl)amino]methyl]piperidin-4-ol
CID 62221672
N-[2-(azetidin-3-yl)ethyl]-N,1-dimethylpiperidin-4-amine
CID 116679267
2-[(4-hydroxypiperidin-4-yl)methyl-methylamino]-1-pyrrolidin-1-ylethanone
CID 55048950
1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine
CID 63143290

Frequently Asked Questions

What is the IUPAC name of 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol?
The IUPAC name of 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol (CID 55048858) is 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol.
What is the SMILES notation for 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol?
The canonical SMILES for 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol is CN1CCC(N(C)CC2(O)CCNCC2)CC1.
What is the InChIKey of 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol?
The InChIKey is QTLNUHWNRSWKIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-15-9-3-12(4-10-15)16(2)11-13(17)5-7-14-8-6-13/h12,14,17H,3-11H2,1-2H3.
What are the key properties of 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol?
4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol has a molecular weight of 241.38 g/mol, XLogP of 0.13, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol is sourced from PubChem (CID 55048858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).